3-(2,4-Difluorophenyl)-3-oxopropanenitrile

Modify Date: 2025-08-25 01:34:08

3-(2,4-Difluorophenyl)-3-oxopropanenitrile Structure
3-(2,4-Difluorophenyl)-3-oxopropanenitrile structure
Common Name 3-(2,4-Difluorophenyl)-3-oxopropanenitrile
CAS Number 71682-97-8 Molecular Weight 181.139
Density 1.3±0.1 g/cm3 Boiling Point 304.0±32.0 °C at 760 mmHg
Molecular Formula C9H5F2NO Melting Point N/A
MSDS N/A Flash Point 137.7±25.1 °C

 Names

Name 3-(3,4-difluorophenyl)-3-oxopropanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 304.0±32.0 °C at 760 mmHg
Molecular Formula C9H5F2NO
Molecular Weight 181.139
Flash Point 137.7±25.1 °C
Exact Mass 181.033920
PSA 40.86000
LogP 0.69
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.498
InChIKey DMUDJKIYVPYJNF-UHFFFAOYSA-N
SMILES N#CCC(=O)c1ccc(F)c(F)c1

 Safety Information

Risk Phrases 36/37/38
Safety Phrases 26-36/37/39
HS Code 2926909090

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

3,4-Difluoro-b-oxo-benzenepropanenitrile
3-(2,4-Difluorophenyl)-3-oxopropanenitrile
Benzenepropanenitrile, 2,4-difluoro-β-oxo-
3',4'-difluorobenzoylacetonitrile
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